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7,8-DICHLORO-2,4-DIAMINO-10-METHYL-PYRIMIDO-[4,5-B]-5-QUINOLONE

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7,8-DICHLORO-2,4-DIAMINO-10-METHYL-PYRIMIDO-[4,5-B]-5-QUINOLONE
SpectraBase Compound ID 5WkppSYKwha
InChI InChI=1S/C12H9Cl2N5O/c1-19-7-3-6(14)5(13)2-4(7)9(20)8-10(15)17-12(16)18-11(8)19/h2-3H,1H3,(H4,15,16,17,18)
InChIKey DMWFRCJFHMRTIK-UHFFFAOYSA-N
Mol Weight 310.14 g/mol
Molecular Formula C12H9Cl2N5O
Exact Mass 309.018415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Gsox0dke4C
Name 7,8-DICHLORO-2,4-DIAMINO-10-METHYL-PYRIMIDO-[4,5-B]-5-QUINOLONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9Cl2N5O
InChI InChI=1S/C12H9Cl2N5O/c1-19-7-3-6(14)5(13)2-4(7)9(20)8-10(15)17-12(16)18-11(8)19/h2-3H,1H3,(H4,15,16,17,18)
InChIKey DMWFRCJFHMRTIK-UHFFFAOYSA-N
Literature Reference Author J.E.CHARRIS,J.N.DOMINGUEZ,N.GAMBOA,J.ANGEL,N.PINA,M.GUERRA,E .MICHELENA,S.E.LOPEZ
Literature Reference Citation MAGN.RES.CHEM.,40,477(2002)
Literature Reference DOI 10.1002/mrc.1024
Molecular Weight 310.142 g/mol
Solvent DMSO-D6
Source File Reference UWKP6876